|
|
| | (αR,βS)-rel-Bedaquiline Basic information |
| Product Name: | (αR,βS)-rel-Bedaquiline | | Synonyms: | (1R,2S)-rac-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(methylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol;cis-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol;(αR,βS)-rel-6-Bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-3-quinolineethanol;3-Quinolineethanol, 6-bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-, (αR,βS)-rel-;Bedaquiline (1R,2S)Isomer;(AlphaR,BetaS)-rel-Bedaquiline;Bedaquiline Fumarate Impurity 40;Glycerol Impurity 108 | | CAS: | 654653-93-7 | | MF: | C32H31BrN2O2 | | MW: | 555.51 | | EINECS: | | | Product Categories: | Aromatics, Heterocycles, Inhibitors, Pharmaceuticals, Intermediates & Fine Chemicals | | Mol File: | 654653-93-7.mol |  |
| | (αR,βS)-rel-Bedaquiline Chemical Properties |
| Melting point | >180°C (dec.) | | Boiling point | 702.7±60.0 °C(Predicted) | | density | 1.322±0.06 g/cm3(Predicted) | | storage temp. | -20°C Freezer, Under Inert Atmosphere | | solubility | Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly) | | pka | 13.05±0.29(Predicted) | | form | Solid | | color | Off-White to Pale Yellow |
| | (αR,βS)-rel-Bedaquiline Usage And Synthesis |
| Chemical Properties | Off-white Solid | | Uses | (αR,βS)-rel-Bedaquiline is a promising diarylquinoline candidate in clinical development for the treatment of tuberculosis. (αR,βS)-rel-Bedaquiline inhibits mycobacterial ATP synthase and displays high activity against both drug-susceptible and multidrug-resistant strains of Mycobacterium tuberculosis. | | Definition | ChEBI: Bedaquiline is a quinoline-based antimycobacterial drug used (as its fumarate salt) for the treatment of pulmonary multi-drug resistant tuberculosis by inhibition of ATP synthase, an enzyme essential for the replication of the mycobacteria. It has a role as an antitubercular agent and an ATP synthase inhibitor. It is a member of quinolines, a member of naphthalenes, an organobromine compound, an aromatic ether, a tertiary alcohol and a tertiary amino compound. It is a conjugate base of a bedaquiline(2+). |
| | (αR,βS)-rel-Bedaquiline Preparation Products And Raw materials |
|